4-(Tert-butoxycarbonyl)morpholine-3-carboxylic acid

Base Information

• Chemical Name: 4-(Tert-butoxycarbonyl)morpholine-3-carboxylic acid
• CAS No.: 212650-43-6
• Molecular Formula: C10H17NO5
• Molecular Weight: 231.249
• Hs Code.: 2934999090
• European Community (EC) Number: 672-335-6
• DSSTox Substance ID: DTXSID10375034
• Mol file: 212650-43-6.mol

Synonyms:212650-43-6;4-boc-3-morpholinecarboxylic acid;4-(tert-butoxycarbonyl)morpholine-3-carboxylic acid;Morpholine-3,4-dicarboxylic acid 4-tert-butyl ester;N-Boc-morpholine-3-carboxylic acid;4-N-Boc-3-morpholinecarboxylic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic Acid;MFCD02683057;N-BOC-MORPHOLINE-3CARBOXYLIC ACID;4-[(tert-butoxy)carbonyl]morpholine-3-carboxylic acid;(3R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic acid;(3S)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic acid;4-boc-morpholine-3-carboxylic acid;MFCD04114909;4-Boc-3-morpholinecarboxylicAcid;n-boc-3-morpholinecarboxylic acid;BOC-S-MO3C-OH;(R)-Morpholine-3,4-dicarboxylic acid 4-tert-butylester;(S)-Morpholine-3,4-dicarboxylic acid 4-tert-butylester;((3S)-4-[(tert-butoxy)carbonyl]morpholine-3-carboxylic acid);SCHEMBL154453;DTXSID10375034;KVXXEKIGMOEPSA-UHFFFAOYSA-N;3,4-Morpholinedicarboxylicacid, 4-(1,1-dimethylethyl) ester;BCP14812;CS-M0709;AKOS010055152;AB19217;AB19231;AC-6551;DS-10609;SY004057;SY006448;SY006449;A4595;AM20090181;FT-0647429;FT-0656441;FT-0656573;EN300-91631;morpholine-3,4-dicarboxylic acid-4-tert-butyl ester;morpholine-3, 4-dicarboxylic acid 4-tert-butyl ester;Z1262327687;4-{[(1,1-Dimethylethyl)oxy]carbonyl}morpholine-3-carboxylic acid;Morpholine-3,4-dicarboxylic acid 4-tert-butyl ester, AldrichCPR;4-Boc-3-morpholinecarboxylic Acid

Chemical Property of 4-(Tert-butoxycarbonyl)morpholine-3-carboxylic acid

Chemical Property:

• Appearance/Colour: solid
• Vapor Pressure: 1.8E-06mmHg at 25°C
• Boiling Point: 369.5 °C at 760 mmHg
• PKA: 3.53±0.20(Predicted)
• Flash Point: 177.3 °C
• PSA: 76.07000
• Density: 1.23 g/cm³
• LogP: 0.64480
• Storage Temp.: 2-8°C
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 231.11067264
• Heavy Atom Count: 16
• Complexity: 283

Purity/Quality:

97% ^*data from raw suppliers

4-(tert-Butoxycarbonyl)morpholine-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-51-36
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCOCC1C(=O)O

Technology Process of 4-(Tert-butoxycarbonyl)morpholine-3-carboxylic acid

There total 8 articles about 4-(Tert-butoxycarbonyl)morpholine-3-carboxylic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 95.0%

morpholine-3-carboxylic acid hydrochloride (66937-99-3) + di-tert-butyl dicarbonate (24424-99-5) → 4-(tert-butoxycarbonyl)morpholine-3-carboxylic acid (212650-43-6)

Guidance literature:

With sodium hydroxide; In methanol; at 20 ℃; for 4h; pH=Ca. 11; Cooling with ice;

Reference yield: 90.0%

→ 4-(tert-butoxycarbonyl)morpholine-3-carboxylic acid (212650-43-6)

Guidance literature:

Reference yield: 84.0%

morpholine-3-carboxylic acid (77873-76-8,106825-81-4) + di-tert-butyl dicarbonate (24424-99-5) → 4-(tert-butoxycarbonyl)morpholine-3-carboxylic acid (212650-43-6)

Guidance literature:

morpholine-3-carboxylic acid; di-tert-butyl dicarbonate; With potassium carbonate; In water; acetone; at 0 - 20 ℃; for 24h;

With hydrogenchloride; In water;

upstream raw materials:

morpholine-3-carboxylic acid

di-tert-butyl dicarbonate

tert-Butyl 3-(hydroxymethyl)-4-morpholinecarboxylate

methyl 3-morpholine-carboxylate

Downstream raw materials:

morpholine-3,4-dicarboxylic acid 4-tert-butyl ester 3-methyl ester

C₂₉H₃₂N₄O₅

3(R,S)-{4-[3-(5-chloro-2-hydroxy-phenyl)-1-(2-hydroxy-ethyl)-1H-pyrazol-4-ylethynyl]-phenylcarbamoyl}-morpholine-4-carboxylic acid tert-butyl ester

1,1-dimethylethyl 3-{[({3-[(3-{[(5-chloro-2-thienyl)sulfonyl]amino}-4-hydroxy-1H-indazol-1-yl)methyl]phenyl}methyl)amino]carbonyl}-4-morpholinecarboxylate